1,3,5-Trichlorobenzene

CAT: 1596-AR-B06403-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-B06403-01Size:10 Units

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CAS Number

108-70-3

Molecular Formula

C6H3Cl3

Molecular Weight

181.44

API Name

Benzene

Chemical Information

1,3,5-Trichlorobenzene

1,3,5-trichlorobenzene is a trichlorobenzene carrying chloro substituents at positions 1, 3 and 5.

CAS Number	108-70-3
PubChem CID	7950
IUPAC Name	1,3,5-trichlorobenzene
Molecular Formula	C6H3Cl3
Molecular Weight	181.4
XLogP	4.2
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Heavy Atom Count	9
Formal Charge	0
Complexity	63

SMILES

C1=C(C=C(C=C1Cl)Cl)Cl

InChI

InChI=1S/C6H3Cl3/c7-4-1-5(8)3-6(9)2-4/h1-3H

InChIKey

XKEFYDZQGKAQCN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 108-70-3

CID: 7950

Formula: C6H3Cl3

MW: 181.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	181.4
XLogP3	4.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	179.930033
Monoisotopic Mass	179.930033
Topological Polar Surface Area	0 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	63.3
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-S01523-01	1,1,3,3,5,5-Hexamethyltrisiloxane-1,5-diol
AR-M05357-01	1,3,5-Triphenylcyclohexane
AR-B06483-01	1,3,5-Trimethoxybenzene
AR-S01524-01	1,1,3,3,5,5,7,7-Octamethyl-1,7-Tetrasiloxanediol
AR-M03288-01	1,3-Benzenedimethanol, 5- (3-pyridinyl)
AR-C08616-01	5-Bromo-5-Nitro-1,3-Dioxane
AR-A01399-01	5,7-Dimethyltricyclo[3.3.1.1;3,7]decane-1,3-diamine
AR-B06649-01	1,2,3,5-Tetramethoxybenzene
AR-A01403-01	1,3,5-Tribromo Adamantane
AR-P01799-01	1,3,5-Trinitrobenzol-d3

Catalog	Name
290735-01	1,3,5-Trichlorobenzene
T19290-01	1,3,5-Trichlorobenzene 98%
T773791	1,3,5-Trichlorobenzene-d3
TRC-B688538-500MG	5-Bromo-1,2,3-trichlorobenzene
sc-265445	2-Bromo-1,3,5-trichlorobenzene
OR1099929	2- (Benzyloxy) -1,3,5-trichlorobenzene
OR1029064-01	1-Bromo-2,3,5-Trichlorobenzene
sc-297653	1- (Bromomethyl) -2,3,5-trichlorobenzene
OR1099223	2-Butoxy-1,3,5-trichlorobenzene
TRC-T773805-50G	1,2,3-Trichlorobenzene